NCID-ZINC03954009 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.5570 1.5540 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 0.0520 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -0.5990 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -1.9740 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -2.7100 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -2.0460 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.6700 -1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -2.9630 -3.1390 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -3.8860 -3.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -2.0130 -4.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -3.8660 -2.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -5.2610 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -3.2680 -3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -4.0730 -0.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -4.6910 0.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -6.0480 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -6.7740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -8.2380 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -9.0130 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -10.3750 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -10.9990 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -10.2560 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -8.8660 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -8.1160 1.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -8.5700 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -6.7720 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -6.1490 2.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -6.1440 -0.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 1.8450 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 1.9260 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 1.9790 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.0290 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -2.4810 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -0.1550 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -5.8090 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -5.7130 -2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -5.3010 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 -2.8190 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -4.0400 -3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -2.5000 -4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -8.5340 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -10.9720 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -12.0770 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -10.7520 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -5.1830 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 28 45 1 0 0 0 0 M END